2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide

C17H26N2O3 — CID 51186865

IUPAC2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide
SMILESCOc1ccc(C(=O)NCC(C)(C)N2CCCCC2)c(O)c1
InChIInChI=1S/C17H26N2O3/c1-17(2,19-9-5-4-6-10-19)12-18-16(21)14-8-7-13(22-3)11-15(14)20/h7-8,11,20H,4-6,9-10,12H2,1-3H3,(H,18,21)
InChIKeyQJIVSFYIKRZNSC-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.40
Rot. Bonds5

About 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide

2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide (PubChem CID 51186865) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide
PubChem CID51186865
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide
SMILESCOc1ccc(C(=O)NCC(C)(C)N2CCCCC2)c(O)c1
InChIInChI=1S/C17H26N2O3/c1-17(2,19-9-5-4-6-10-19)12-18-16(21)14-8-7-13(22-3)11-15(14)20/h7-8,11,20H,4-6,9-10,12H2,1-3H3,(H,18,21)
InChIKeyQJIVSFYIKRZNSC-UHFFFAOYSA-N
XLogP2.40
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide (CID 51186865) is 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide is COc1ccc(C(=O)NCC(C)(C)N2CCCCC2)c(O)c1.
What is the InChIKey of 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide?
The InChIKey is QJIVSFYIKRZNSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-17(2,19-9-5-4-6-10-19)12-18-16(21)14-8-7-13(22-3)11-15(14)20/h7-8,11,20H,4-6,9-10,12H2,1-3H3,(H,18,21).
What are the key properties of 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide?
2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide has a molecular weight of 306.41 g/mol, XLogP of 2.40, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide is sourced from PubChem (CID 51186865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).